Geometry & MOs

Info

ID:	249385
PubChem CID:	103089104
Reduced:	SN3C14H31 (1)
Stoich.:	AB3C14D31 (1)
Weight, g/mol:	337.98073
ΔH_f, kcal/mol:	-10.24
Dipole, Da:	2.99
IP(EA), eV:	-8.24(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-amino-1H-pyrazol-4-yl)methyl]-2,4-dichloro-3-fluorobenzenesulfonamide

Drug info:

PubChemData

Smile

CN(C)C1(CCC1)CN(C)C(CCCSC)CN

DOS

IR

Vibrations