Geometry & MOs

Info

ID:	345606
PubChem CID:	127269906
Reduced:	ON5C16H27 (1)
Stoich.:	AB5C16D27 (1)
Weight, g/mol:	263.17461
ΔH_f, kcal/mol:	-35.69
Dipole, Da:	4.47
IP(EA), eV:	-9.28(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1(CCN(CC1)C(=O)NCC2=NN=C3N2CCCC3)C

DOS

IR

Vibrations