Geometry & MOs

Info

ID:	379013
PubChem CID:	134228880
Reduced:	N2O2C15H16 (1)
Stoich.:	A2B2C15D16 (1)
Weight, g/mol:	468.0007
ΔH_f, kcal/mol:	-37.44
Dipole, Da:	4.37
IP(EA), eV:	-8.29(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(3E,5E)-5-bromohepta-1,3,5-trien-3-yl]-3-[(2,5-dichlorophenyl)methyl]imidazole-4-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)/C=C/C1=CC=C(N1)C2=CC=C(C=C2)N

DOS

IR

Vibrations