Geometry & MOs

Info

ID:	335536
PubChem CID:	127254398
Reduced:	N3O5C27H31 (1)
Stoich.:	A3B5C27D31 (1)
Weight, g/mol:	294.111676
ΔH_f, kcal/mol:	-165.49
Dipole, Da:	2.94
IP(EA), eV:	-8.83(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-5-methyl-N-phenyl-2-pyridin-3-ylimidazole-4-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C2=C(C=C1)C3N(C(=O)C4=CC=CC=C4N3C2=O)CCC(=O)NC5CCCCCC5)OC

DOS

IR

Vibrations