Geometry & MOs

Info

ID:	357028
PubChem CID:	127293097
Reduced:	O2N3C17H29 (1)
Stoich.:	A2B3C17D29 (1)
Weight, g/mol:	366.10552
ΔH_f, kcal/mol:	-121.33
Dipole, Da:	4.67
IP(EA), eV:	-8.67(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-(1-cyclopentylpyrrolidin-3-yl)-5-cyclopropyl-1H-pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC(=O)N(CC1)CC(=O)NC2CCN(C2)C3CCCC3

DOS

IR

Vibrations