Geometry & MOs

Info

ID:	146359
PubChem CID:	53675715
Reduced:	NC26H37 (1)
Stoich.:	AB26C37 (1)
Weight, g/mol:	185.070145
ΔH_f, kcal/mol:	-44.98
Dipole, Da:	1.39
IP(EA), eV:	-7.64(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1H-imidazol-2-yl)benzotriazole

Drug info:

PubChemData

Smile

CC1CC(NC2=C1C(=C(C(=C2C)C)C3=C(C(=C(C(=C3C)C)C)C)C)C)(C)C

DOS

IR

Vibrations