Geometry & MOs

Info

ID:	189008
PubChem CID:	77802513
Reduced:	N2O8C23H34 (1)
Stoich.:	A2B8C23D34 (1)
Weight, g/mol:	394.168128
ΔH_f, kcal/mol:	-365.97
Dipole, Da:	12.98
IP(EA), eV:	-10.11(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-(2-trityl-1H-imidazol-5-yl)prop-2-enoic acid

Drug info:

PubChemData

Smile

CCCCOC(=O)C(C(CC(C)C)C(=O)O)O.C1C(NC(=O)O1)(CC2=CC=CC=C2)C(=O)N

DOS

IR

Vibrations