Geometry & MOs

Info

ID:	402195
PubChem CID:	135054870
Reduced:	N2O3C9H10 (3)
Stoich.:	A2B3C9D10 (3)
Weight, g/mol:	289.108977
ΔH_f, kcal/mol:	-263.91
Dipole, Da:	4.53
IP(EA), eV:	-9.05(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trifluoro-N-(4-fluorophenyl)-N-[(3R)-hex-1-en-3-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)CC(=O)N(CC(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-])C3=CC=CC=C3NC(=O)OC(C)(C)C

DOS

IR

Vibrations