Geometry & MOs

Info

ID:	187912
PubChem CID:	77642717
Reduced:	ClN2H11C12 (1)
Stoich.:	AB2C11D12 (1)
Weight, g/mol:	450.061648
ΔH_f, kcal/mol:	61.01
Dipole, Da:	2.0
IP(EA), eV:	-8.17(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-(2-chlorophenyl)sulfonyl-2,6-difluorophenyl]methylamino]-2-phenylacetamide

Drug info:

PubChemData

Smile

CC1=C[N+]2=CC=CC3=CC=CC(=N1)C32.[Cl-]

DOS

IR

Vibrations