Geometry & MOs

Info

ID:	27743
PubChem CID:	823364
Reduced:	NSO3C16H17 (1)
Stoich.:	ABC3D16E17 (1)
Weight, g/mol:	306.100442
ΔH_f, kcal/mol:	-67.02
Dipole, Da:	5.96
IP(EA), eV:	-9.4(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylnaphthalen-1-yl)-4-nitrobenzamide

Drug info:

PubChemData

Smile

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C3=CC=CC=C3

DOS

IR

Vibrations