Geometry & MOs

Info

ID:	124488
PubChem CID:	50884983
Reduced:	O7H14C18 (1)
Stoich.:	A7B14C18 (1)
Weight, g/mol:	373.04259
ΔH_f, kcal/mol:	-223.24
Dipole, Da:	6.14
IP(EA), eV:	-9.6(-2.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-6-[(4-methoxyphenyl)iminomethyl]-1,3-dimethylbenzimidazol-2-one

Drug info:

PubChemData

Smile

CC1(OC(=O)C(=CC2=CC=C(O2)C3=CC=C(C=C3)C(=O)O)C(=O)O1)C

DOS

IR

Vibrations