Geometry & MOs

Info

ID:

296868

PubChem CID:

117598021

Reduced:

N2O2C43H62 (1)

Stoich.:

A2B2C43D62 (1)

Weight, g/mol:

566.236992

ΔHf, kcal/mol:

-121.73

Dipole, Da:

4.49

IP(EA), eV:

 -8.89(-0.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-(2-chlorophenothiazin-10-yl)-N,N-dimethylpropan-1-amine;4,8-dimethyl-12-methylidene-3,14-dioxatricyclo[9.3.0.02,4]tetradec-7-en-13-one

Drug info:

PubChemData

Smile

CC(CCC=C(C)C)C1CCC2(C1(CCC3=C2CCC4C3(CCC(C4(C)C)O)C)C)C.C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2

DOS

IR

Vibrations