Geometry & MOs

Info

ID:	169712
PubChem CID:	75140933
Reduced:	NOC10H11 (3)
Stoich.:	ABC10D11 (3)
Weight, g/mol:	475.225977
ΔH_f, kcal/mol:	-44.74
Dipole, Da:	2.92
IP(EA), eV:	-9.02(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-[4-[2-oxo-2-(2-pyridin-2-ylethylamino)ethyl]phenyl]-3-phenylprop-2-enamide

Drug info:

PubChemData

Smile

C1COCCN1CCNC(=O)CC2=CC=C(C=C2)N(CC3=CC=CC=C3)C(=O)C=CC4=CC=CC=C4

DOS

IR

Vibrations