Geometry & MOs

Info

ID:	395314
PubChem CID:	135025187
Reduced:	NOH21C23 (1)
Stoich.:	ABC21D23 (1)
Weight, g/mol:	305.060742
ΔH_f, kcal/mol:	30.18
Dipole, Da:	3.34
IP(EA), eV:	-8.2(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8-chloropyrido[1,2-b]isoindol-6-yl)-phenylmethanone

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC2=C(N3C=CC=CC3=C2C=C1)C(=O)C4=CC=CC=C4

DOS

IR

Vibrations