Geometry & MOs

Info

ID:	66366
PubChem CID:	46504454
Reduced:	N3O5C29H31 (1)
Stoich.:	A3B5C29D31 (1)
Weight, g/mol:	501.226371
ΔH_f, kcal/mol:	-151.0
Dipole, Da:	2.18
IP(EA), eV:	-8.32(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-[[2-(4-methoxyanilino)-2-oxo-1-phenylethyl]-methylcarbamoyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)OC)NC(=O)C3CCCN3C(=O)OCC4=CC=CC=C4

DOS

IR

Vibrations