Geometry & MOs

Info

ID:	421267
PubChem CID:	135115669
Reduced:	OSN3C17H23 (1)
Stoich.:	ABC3D17E23 (1)
Weight, g/mol:	352.101683
ΔH_f, kcal/mol:	-0.93
Dipole, Da:	5.04
IP(EA), eV:	-9.13(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(difluoromethyl)-N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-1H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N=CC=C1)CC(C)N(C)CC(=O)NCC2=CC=CS2

DOS

IR

Vibrations