Geometry & MOs

Info

ID:	18897
PubChem CID:	550784
Reduced:	N3O6C16H19 (1)
Stoich.:	A3B6C16D19 (1)
Weight, g/mol:	349.127385
ΔH_f, kcal/mol:	-171.08
Dipole, Da:	3.23
IP(EA), eV:	-9.25(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7-hydroxy-11-methoxy-5,12-dimethyl-10,13-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),11-dien-8-yl)methyl carbamate

Drug info:

PubChemData

Smile

CC1=C(C(=O)C2=C(C1=O)N3CC4C(C3(C2COC(=O)N)O)N4C)OC

DOS

IR

Vibrations