Geometry & MOs

Info

ID:	200142
PubChem CID:	79353518
Reduced:	ON4C13H22 (1)
Stoich.:	AB4C13D22 (1)
Weight, g/mol:	230.127994
ΔH_f, kcal/mol:	-12.29
Dipole, Da:	2.53
IP(EA), eV:	-8.67(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine

Drug info:

PubChemData

Smile

CC1(C(C1(C)C)CNC(=O)CN2C=CC(=N2)N)C

DOS

IR

Vibrations