Geometry & MOs

Info

ID:	199336
PubChem CID:	79231302
Reduced:	ON2C18H26 (1)
Stoich.:	AB2C18D26 (1)
Weight, g/mol:	286.142976
ΔH_f, kcal/mol:	-11.57
Dipole, Da:	2.02
IP(EA), eV:	-8.53(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-amino-1-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]benzimidazol-2-yl]methanol

Drug info:

PubChemData

Smile

COC1=CC2=C(CCCC2NC3CCN(C3)C4CC4)C=C1

DOS

IR

Vibrations