Geometry & MOs

Info

ID:	68977
PubChem CID:	46514557
Reduced:	N6O6C23H26 (1)
Stoich.:	A6B6C23D26 (1)
Weight, g/mol:	381.097012
ΔH_f, kcal/mol:	-130.39
Dipole, Da:	4.11
IP(EA), eV:	-9.15(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[methyl(morpholin-4-ylsulfonyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide

Drug info:

PubChemData

Smile

COCCN(C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N)C(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

DOS

IR

Vibrations