Geometry & MOs

Info

ID:	426190
PubChem CID:	135142358
Reduced:	N2C11H16 (1)
Stoich.:	A2B11C16 (1)
Weight, g/mol:	205.121512
ΔH_f, kcal/mol:	20.84
Dipole, Da:	0.8
IP(EA), eV:	-7.87(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,4-dimethylbenzotriazol-5-yl)propan-2-ol

Drug info:

PubChemData

Smile

C/C=C/C1=C(C(=C(C=C1)NC)N)C

DOS

IR

Vibrations