Geometry & MOs

Info

ID:	29668
PubChem CID:	836331
Reduced:	NOC16H17 (1)
Stoich.:	ABC16D17 (1)
Weight, g/mol:	254.141913
ΔH_f, kcal/mol:	-17.07
Dipole, Da:	3.65
IP(EA), eV:	-8.91(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-methylpyridin-2-yl)-4-phenylbutanamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=O)C2=CC=CC=C2C

DOS

IR

Vibrations