Geometry & MOs

Info

ID:	403064
PubChem CID:	135058570
Reduced:	NOC18H19 (1)
Stoich.:	ABC18D19 (1)
Weight, g/mol:	330.125594
ΔH_f, kcal/mol:	-12.93
Dipole, Da:	3.19
IP(EA), eV:	-8.95(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-benzoyl-2-phenylphenyl)propanoic acid

Drug info:

PubChemData

Smile

CC1CCC2=C(N1C(=O)C)C(=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations