Geometry & MOs

Info

ID:	51225
PubChem CID:	12013865
Reduced:	ON2H12C19 (1)
Stoich.:	AB2C12D19 (1)
Weight, g/mol:	332.079707
ΔH_f, kcal/mol:	47.23
Dipole, Da:	7.04
IP(EA), eV:	-8.61(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-nitro-7-oxobenzo[a]phenalen-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=NC2=C(N1)C=C3C4=CC=CC=C4C(=O)C5=CC=CC2=C53

DOS

IR

Vibrations