Geometry & MOs

Info

ID:	335426
PubChem CID:	127254288
Reduced:	ClPN3O4H11C12 (1)
Stoich.:	ABC3D4E11F12 (1)
Weight, g/mol:	295.064303
ΔH_f, kcal/mol:	-168.17
Dipole, Da:	5.48
IP(EA), eV:	-9.24(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-1H-benzimidazol-2-yl(phenyl)methanamine;dihydrochloride

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)NC(=N2)C3=CN=C(C=C3)Cl.OP(=O)(O)O

DOS

IR

Vibrations