Geometry & MOs

Info

ID:	153980
PubChem CID:	56313338
Reduced:	S2O3N4C19H20 (1)
Stoich.:	A2B3C4D19E20 (1)
Weight, g/mol:	374.138817
ΔH_f, kcal/mol:	-31.97
Dipole, Da:	6.29
IP(EA), eV:	-8.35(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)-2-thiophen-3-ylethyl]-1-propan-2-yl-5-(trifluoromethyl)pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NS(=O)(=O)C2=C(SC=C2)C(=O)NC3=CN=C(C=C3)N(C)C

DOS

IR

Vibrations