Geometry & MOs

Info

ID:	438728
PubChem CID:	135228481
Reduced:	NOC25H31 (1)
Stoich.:	ABC25D31 (1)
Weight, g/mol:	375.231063
ΔH_f, kcal/mol:	7.41
Dipole, Da:	3.06
IP(EA), eV:	-7.43(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[(Z)-1-amino-3-iminoprop-1-en-2-yl]-6-tert-butyl-10-methyl-3-prop-1-en-2-yl-6,7-dihydrobenzo[a]quinolizin-2-one

Drug info:

PubChemData

Smile

CC(=C)C1=C(C=C2C(=C1)CC(N3C2=CC(=C)C(=C3)C(=C)C)C(C)(C)C)OC

DOS

IR

Vibrations