Geometry & MOs

Info

ID:	334858
PubChem CID:	127253664
Reduced:	N2O5H16C23 (1)
Stoich.:	A2B5C16D23 (1)
Weight, g/mol:	384.132136
ΔH_f, kcal/mol:	-88.43
Dipole, Da:	5.35
IP(EA), eV:	-8.49(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3,4-dimethoxyphenyl)-1-hydroxy-2-(7-methoxy-1,3-benzodioxol-5-yl)-5-methylimidazole

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C2=C(N3C=CC=CC3=N2)C4=C(C5=CC=CC=C5OC4=O)O)O

DOS

IR

Vibrations