Geometry & MOs

Info

ID:	377194
PubChem CID:	134223233
Reduced:	BrN3C7H10 (1)
Stoich.:	AB3C7D10 (1)
Weight, g/mol:	200.99016
ΔH_f, kcal/mol:	55.7
Dipole, Da:	5.76
IP(EA), eV:	-9.77(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-1-(cyclopropylmethyl)triazole

Drug info:

PubChemData

Smile

C1CC(C1)CN2C=C(N=N2)Br

DOS

IR

Vibrations