Geometry & MOs

Info

ID:	149313
PubChem CID:	53788985
Reduced:	O2N4C9H10 (1)
Stoich.:	A2B4C9D10 (1)
Weight, g/mol:	466.236876
ΔH_f, kcal/mol:	1.38
Dipole, Da:	10.3
IP(EA), eV:	-9.34(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[4-[5-(4-aminophenyl)-4-[4-(diethylamino)phenyl]-1H-imidazol-2-yl]phenyl]prop-2-enoate

Drug info:

PubChemData

Smile

CC1=CC(=O)N=C(N1)N2C=C(C(=N2)C)O

DOS

IR

Vibrations