Geometry & MOs

Info

ID:	416840
PubChem CID:	135090566
Reduced:	S2N3O4C14H23 (1)
Stoich.:	A2B3C4D14E23 (1)
Weight, g/mol:	335.166748
ΔH_f, kcal/mol:	-148.3
Dipole, Da:	7.84
IP(EA), eV:	-9.69(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[[3-(2-methoxyethyl)imidazol-4-yl]methyl]piperidin-4-yl]-thiophen-2-ylmethanol

Drug info:

PubChemData

Smile

CCCC1=NC(=CS1)C(=O)N[C@H]2COC[C@H]2CS(=O)(=O)N(C)C

DOS

IR

Vibrations