Geometry & MOs

Info

ID:	357021
PubChem CID:	127293090
Reduced:	SO2N4C17H22 (1)
Stoich.:	AB2C4D17E22 (1)
Weight, g/mol:	352.226312
ΔH_f, kcal/mol:	-50.59
Dipole, Da:	1.32
IP(EA), eV:	-8.74(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopentylpyrrolidin-3-yl)-4-(3,5-dimethylpyrazol-1-yl)benzamide

Drug info:

PubChemData

Smile

C1CCC(C1)N2CCC(C2)NC(=O)CN3C=NC4=C(C3=O)C=CS4

DOS

IR

Vibrations