Geometry & MOs

Info

ID:	168374
PubChem CID:	74959083
Reduced:	SCl2N6O6C40H54 (1)
Stoich.:	AB2C6D6E40F54 (1)
Weight, g/mol:	280.121178
ΔH_f, kcal/mol:	-301.84
Dipole, Da:	6.69
IP(EA), eV:	-9.49(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-benzyl-2-phenyl-1,4-dihydroimidazole-5-carboxylic acid

Drug info:

PubChemData

Smile

CCNC(=O)C1(CCCN(C1)C(=O)C(CC2=CC(=C(C=C2)Cl)Cl)NC(=O)N3CCC(CC3)NC(=O)CCCCCNC(=O)CSC(=O)C)CC4=CC=CC=C4

DOS

IR

Vibrations