Geometry & MOs

Info

ID:	31237
PubChem CID:	855300
Reduced:	NOC10H13 (2)
Stoich.:	ABC10D13 (2)
Weight, g/mol:	334.168128
ΔH_f, kcal/mol:	-101.63
Dipole, Da:	5.77
IP(EA), eV:	-8.87(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)NC(=O)C(=C2)CN(C3CCCCC3)C(=O)C

DOS

IR

Vibrations