Geometry & MOs

Info

ID:	138216
PubChem CID:	52329037
Reduced:	NOC15H23 (1)
Stoich.:	ABC15D23 (1)
Weight, g/mol:	315.102606
ΔH_f, kcal/mol:	-59.48
Dipole, Da:	3.56
IP(EA), eV:	-9.3(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-chlorophenyl)methyl]-N-methyl-4-oxo-4-phenylbutanamide

Drug info:

PubChemData

Smile

CCC[C@H](C)C(=O)NCCCC1=CC=CC=C1

DOS

IR

Vibrations