Geometry & MOs

Info

ID:	15330
PubChem CID:	438042
Reduced:	ClN3O6C20H24 (1)
Stoich.:	AB3C6D20E24 (1)
Weight, g/mol:	437.135363
ΔH_f, kcal/mol:	-97.33
Dipole, Da:	6.35
IP(EA), eV:	-8.4(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-methoxy-3,3,12-trimethylpyrano[2,3-c]acridin-7-ylidene)hydrazine;trihydroxy(oxo)-lambda5-chlorane

Drug info:

PubChemData

Smile

CC1(C=CC2=C3C(=C(C=C2O1)OC)C(=NN)C4=CC=CC=C4N3C)C.OCl(=O)(O)O

DOS

IR

Vibrations