Geometry & MOs

Info

ID:	328681
PubChem CID:	126726520
Reduced:	FN3O3C26H26 (1)
Stoich.:	AB3C3D26E26 (1)
Weight, g/mol:	459.215806
ΔH_f, kcal/mol:	-91.15
Dipole, Da:	5.13
IP(EA), eV:	-9.39(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-2-[hydroxy(diphenyl)methyl]-N-[(2R)-2-hydroxypropyl]-4-methoxybenzimidazole-5-carboxamide

Drug info:

PubChemData

Smile

CCN1C2=C(C(=CC(=C2)C(=O)NC[C@@H](C)O)F)N=C1C(C3=CC=CC=C3)(C4=CC=CC=C4)O

DOS

IR

Vibrations