Geometry & MOs

Info

ID:	295312
PubChem CID:	117526186
Reduced:	N4C15H16 (1)
Stoich.:	A4B15C16 (1)
Weight, g/mol:	259.168462
ΔH_f, kcal/mol:	74.31
Dipole, Da:	4.97
IP(EA), eV:	-8.91(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(oxan-4-yl)-3H-benzimidazol-5-yl]methyl]ethanamine

Drug info:

PubChemData

Smile

CCNCC1=CC2=C(C=C1)N=C(N2)C3=CN=CC=C3

DOS

IR

Vibrations