Geometry & MOs

Info

ID:	29672
PubChem CID:	836348
Reduced:	NOC18H21 (1)
Stoich.:	ABC18D21 (1)
Weight, g/mol:	253.146664
ΔH_f, kcal/mol:	-18.73
Dipole, Da:	3.42
IP(EA), eV:	-9.31(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methylphenyl)-4-phenylbutanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCCC(=O)NCCC2=CC=CC=C2

DOS

IR

Vibrations