Geometry & MOs

Info

ID:	199339
PubChem CID:	79231382
Reduced:	ON4C16H18 (1)
Stoich.:	AB4C16D18 (1)
Weight, g/mol:	286.142976
ΔH_f, kcal/mol:	64.86
Dipole, Da:	3.83
IP(EA), eV:	-8.24(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CN2C3=C(C=C(C=C3)N)N=C2C4CC4

DOS

IR

Vibrations