Geometry & MOs

Info

ID:	335898
PubChem CID:	127254760
Reduced:	ON3H9C11 (2)
Stoich.:	AB3C9D11 (2)
Weight, g/mol:	366.205576
ΔH_f, kcal/mol:	48.85
Dipole, Da:	5.44
IP(EA), eV:	-8.08(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(4-methoxyphenyl)-2-methylpropyl]-3-[(1-methylbenzimidazol-2-yl)methyl]urea

Drug info:

PubChemData

Smile

CC(=O)N1CC2=C(C1=O)C(C3=CN(C4=CC=CC(=C43)N2)C)C5=C6N=CC=CN6N=C5

DOS

IR

Vibrations