Geometry & MOs

Info

ID:	348132
PubChem CID:	127273194
Reduced:	O2N3C15H27 (1)
Stoich.:	A2B3C15D27 (1)
Weight, g/mol:	277.19026
ΔH_f, kcal/mol:	-131.39
Dipole, Da:	4.74
IP(EA), eV:	-9.33(0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)-4,4-dimethylpiperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC(CC1)NC(=O)N2CCC(CC2)(C)C

DOS

IR

Vibrations