Geometry & MOs

Info

ID:	135277
PubChem CID:	51845508
Reduced:	N2O4C27H30 (1)
Stoich.:	A2B4C27D30 (1)
Weight, g/mol:	446.220557
ΔH_f, kcal/mol:	-105.07
Dipole, Da:	5.67
IP(EA), eV:	-9.19(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[(1S)-2-(butylamino)-1-(2-hydroxyphenyl)-2-oxoethyl]-2-methoxy-N,2-diphenylacetamide

Drug info:

PubChemData

Smile

CCCCNC(=O)[C@@H](C1=CC=CC=C1O)N(C2=CC=CC=C2)C(=O)[C@H](C3=CC=CC=C3)OC

DOS

IR

Vibrations