Geometry & MOs

Info

ID:	171612
PubChem CID:	75404223
Reduced:	NS2O4H15C18 (1)
Stoich.:	AB2C4D15E18 (1)
Weight, g/mol:	347.112605
ΔH_f, kcal/mol:	-90.18
Dipole, Da:	3.32
IP(EA), eV:	-8.95(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-1-thiomorpholin-4-ylethanone

Drug info:

PubChemData

Smile

C1CSCCN1C(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

DOS

IR

Vibrations