Geometry & MOs

Info

ID:	134852
PubChem CID:	51769035
Reduced:	N2O3C23H36 (1)
Stoich.:	A2B3C23D36 (1)
Weight, g/mol:	413.195071
ΔH_f, kcal/mol:	-144.99
Dipole, Da:	4.2
IP(EA), eV:	-9.35(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-tert-butyl-2-[[(2S)-2-methoxy-2-phenylacetyl]-methylamino]-2-(4-nitrophenyl)acetamide

Drug info:

PubChemData

Smile

CCC(CC)[C@H](C(=O)NC1CCCCC1)N(C)C(=O)[C@H](C2=CC=CC=C2)OC

DOS

IR

Vibrations