Geometry & MOs

Info

ID:	29859
PubChem CID:	837805
Reduced:	NO2C18H21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	346.004261
ΔH_f, kcal/mol:	-63.9
Dipole, Da:	2.11
IP(EA), eV:	-8.53(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-2,2,2-trichloro-1-(2-methylanilino)ethyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)[C@@H](C)OC2=CC=CC=C2C)C

DOS

IR

Vibrations