Geometry & MOs

Info

ID:	292235
PubChem CID:	114535745
Reduced:	ClON2C12H19 (1)
Stoich.:	ABC2D12E19 (1)
Weight, g/mol:	308.130697
ΔH_f, kcal/mol:	-38.98
Dipole, Da:	3.62
IP(EA), eV:	-9.33(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)CC2(CCOC2C)CCl

DOS

IR

Vibrations