Geometry & MOs

Info

ID:	197402
PubChem CID:	78962803
Reduced:	SO2N3C9H13 (1)
Stoich.:	AB2C3D9E13 (1)
Weight, g/mol:	192.075959
ΔH_f, kcal/mol:	-49.45
Dipole, Da:	3.31
IP(EA), eV:	-9.17(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1H-imidazol-2-ylmethyl)-2H-triazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(C[C@H]1O)CC(=O)NC2=NC=CS2

DOS

IR

Vibrations