Geometry & MOs

Info

ID:	155383
PubChem CID:	56353014
Reduced:	SN4O5C24H30 (1)
Stoich.:	AB4C5D24E30 (1)
Weight, g/mol:	429.104454
ΔH_f, kcal/mol:	-184.4
Dipole, Da:	8.91
IP(EA), eV:	-8.79(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[2-(3,4-dichlorophenyl)propan-2-yl]pentanamide

Drug info:

PubChemData

Smile

CC1=CC(=C2C=C(NC2=C1)C(=O)NC3=CC(=CC=C3)S(=O)(=O)NCCNC(=O)OC(C)(C)C)C

DOS

IR

Vibrations