Geometry & MOs

Info

ID:	200960
PubChem CID:	79466761
Reduced:	BrN2O2C15H21 (1)
Stoich.:	AB2C2D15E21 (1)
Weight, g/mol:	300.044775
ΔH_f, kcal/mol:	-97.05
Dipole, Da:	2.6
IP(EA), eV:	-9.52(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-4-(4-chloro-3,5-dimethylpyrazol-1-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CCC(C)NC(=O)CCNC(=O)C1=CC(=C(C=C1)C)Br

DOS

IR

Vibrations