Geometry & MOs

Info

ID:	135292
PubChem CID:	51847622
Reduced:	N2O3C29H34 (1)
Stoich.:	A2B3C29D34 (1)
Weight, g/mol:	458.256943
ΔH_f, kcal/mol:	-86.39
Dipole, Da:	4.16
IP(EA), eV:	-8.72(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[(1S)-2-(tert-butylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N,2-diphenylbutanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations