Geometry & MOs

Info

ID:	356985
PubChem CID:	127293051
Reduced:	O2N4C19H28 (1)
Stoich.:	A2B4C19D28 (1)
Weight, g/mol:	373.166938
ΔH_f, kcal/mol:	-72.65
Dipole, Da:	5.57
IP(EA), eV:	-9.0(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chlorophenyl)-N-(1-cyclopentylpyrrolidin-3-yl)-5-methyltriazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)C(=O)N(C)C)C(=O)NC2CCN(C2)C3CCCC3

DOS

IR

Vibrations