Geometry & MOs

Info

ID:	161241
PubChem CID:	57391134
Reduced:	OCl2H2N2C5 (1)
Stoich.:	AB2C2D2E5 (1)
Weight, g/mol:	306.159295
ΔH_f, kcal/mol:	48.94
Dipole, Da:	2.45
IP(EA), eV:	-9.71(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-carbazol-9-yl-N-(2H-tetrazol-5-ylmethyl)propan-1-amine

Drug info:

PubChemData

Smile

C1=C(C=NC(=C1Cl)N=O)Cl

DOS

IR

Vibrations