Geometry & MOs

Info

ID:	207939
PubChem CID:	80472776
Reduced:	NO3C13H17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	207.137162
ΔH_f, kcal/mol:	-89.1
Dipole, Da:	2.57
IP(EA), eV:	-9.8(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(2-methyl-1,2,4-triazol-3-yl)methyl]-3-bicyclo[3.1.0]hexanyl]methanol

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N=C(O1)C2CC3CC3C2)C

DOS

IR

Vibrations