Geometry & MOs

Info

ID:	243412
PubChem CID:	99222766
Reduced:	SN2O4C20H28 (1)
Stoich.:	AB2C4D20E28 (1)
Weight, g/mol:	392.176979
ΔH_f, kcal/mol:	-182.33
Dipole, Da:	3.33
IP(EA), eV:	-9.42(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-(cyclopentylamino)-1-oxopropan-2-yl]-7-(5-methylthiophen-2-yl)-4,7-dioxoheptanamide

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)N[C@@H](C)C(=O)NC2CCCC2

DOS

IR

Vibrations