Geometry & MOs

Info

ID:	349838
PubChem CID:	127276230
Reduced:	O2N3C15H25 (1)
Stoich.:	A2B3C15D25 (1)
Weight, g/mol:	373.166938
ΔH_f, kcal/mol:	-109.44
Dipole, Da:	4.21
IP(EA), eV:	-8.69(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-chlorophenyl)triazol-4-yl]-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCN(CC1)CC2CCCN2C(=O)C3CC(=O)NC3

DOS

IR

Vibrations