Geometry & MOs

Info

ID:	129818
PubChem CID:	51073953
Reduced:	N2O3C17H24 (1)
Stoich.:	A2B3C17D24 (1)
Weight, g/mol:	349.179027
ΔH_f, kcal/mol:	-110.04
Dipole, Da:	3.94
IP(EA), eV:	-9.17(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-6-propan-2-ylphenyl)-3-(4-oxocinnolin-1-yl)propanamide

Drug info:

PubChemData

Smile

CCCCN(CC)C(=O)/C=C/C1=CC=C(C=C1)OCC(=O)N

DOS

IR

Vibrations