Geometry & MOs

Info

ID:	122116
PubChem CID:	50795156
Reduced:	N2O3C24H26 (1)
Stoich.:	A2B3C24D26 (1)
Weight, g/mol:	404.209993
ΔH_f, kcal/mol:	-81.42
Dipole, Da:	3.16
IP(EA), eV:	-9.18(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(cyclohexylmethylamino)-2-oxochromen-3-yl]-3-phenylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(=O)NC2=C(C3=CC=CC=C3OC2=O)NCC4CCCCC4

DOS

IR

Vibrations