Geometry & MOs

Info

ID:	128623
PubChem CID:	51052317
Reduced:	N3O4C21H23 (1)
Stoich.:	A3B4C21D23 (1)
Weight, g/mol:	326.087118
ΔH_f, kcal/mol:	-131.91
Dipole, Da:	5.17
IP(EA), eV:	-9.13(-0.5)
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-(1,3-thiazol-2-yl)pentanamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1CCNC(=O)CC[C@H]2C(=O)NC3=CC=CC=C3C(=O)N2

DOS

IR

Vibrations