Geometry & MOs

Info

ID:	254196
PubChem CID:	103123342
Reduced:	N5H15C16 (1)
Stoich.:	A5B15C16 (1)
Weight, g/mol:	241.132746
ΔH_f, kcal/mol:	115.05
Dipole, Da:	0.58
IP(EA), eV:	-8.28(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-methyl-2-(1-methylpyrazol-3-yl)benzimidazol-5-yl]methanamine

Drug info:

PubChemData

Smile

CN1C2=C(C=CC(=C2)CN)N=C1C3=C4C=CC=CN4N=C3

DOS

IR

Vibrations