Geometry & MOs

Info

ID:	79640
PubChem CID:	49829817
Reduced:	NSO5H17C23 (1)
Stoich.:	ABC5D17E23 (1)
Weight, g/mol:	412.082782
ΔH_f, kcal/mol:	-98.89
Dipole, Da:	3.97
IP(EA), eV:	-8.84(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide

Drug info:

PubChemData

Smile

COC1=CC(=CC2=C1OCO2)C=C3C(=O)N(C(=O)S3)CC4=CC=CC5=CC=CC=C54

DOS

IR

Vibrations