Geometry & MOs

Info

ID:	302326
PubChem CID:	124361245
Reduced:	N3O4C26H33 (1)
Stoich.:	A3B4C26D33 (1)
Weight, g/mol:	440.158351
ΔH_f, kcal/mol:	-158.17
Dipole, Da:	3.98
IP(EA), eV:	-8.87(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (2R)-2-[[(2S)-3-(4-hydroxyphenyl)-1-methoxy-1-oxopropan-2-yl]carbamoyl]-5-oxopyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

C1CC[C@H]([C@H](C1)CC2=CC=CO2)NC(=O)CCC(=O)N3C[C@H]4C[C@@H](C3)C5=CC=CC(=O)N5C4

DOS

IR

Vibrations