Geometry & MOs

Info

ID:	299763
PubChem CID:	117689243
Reduced:	FO2N4C26H27 (1)
Stoich.:	AB2C4D26E27 (1)
Weight, g/mol:	325.142641
ΔH_f, kcal/mol:	-10.61
Dipole, Da:	4.95
IP(EA), eV:	-8.74(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-cyclopropyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methylbenzimidazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)C2(CCCO2)C(C3=C4C(=CC(=C3)C5=C(ON=C5C)C)NC(=N4)C6CC6)F

DOS

IR

Vibrations