Geometry & MOs

Info

ID:	150463
PubChem CID:	53790153
Reduced:	SO3C30H30 (1)
Stoich.:	AB3C30D30 (1)
Weight, g/mol:	245.152812
ΔH_f, kcal/mol:	-48.63
Dipole, Da:	6.53
IP(EA), eV:	-8.45(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(4-aminophenyl)-2-butylimidazol-4-yl]methanol

Drug info:

PubChemData

Smile

CC(C)(C1=CC=CC=C1)C2=CC(=C(C=C2)O)S(=O)C3=C(C=CC(=C3)C(C)(C)C4=CC=CC=C4)O

DOS

IR

Vibrations