Geometry & MOs

Info

ID:	134900
PubChem CID:	51779707
Reduced:	N2O4C33H42 (1)
Stoich.:	A2B4C33D42 (1)
Weight, g/mol:	378.230728
ΔH_f, kcal/mol:	-128.6
Dipole, Da:	1.99
IP(EA), eV:	-8.32(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,2S)-N-tert-butyl-2-[(2,2-diphenylacetyl)-methylamino]pent-3-enamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations