Geometry & MOs

Info

ID:	243444
PubChem CID:	99222799
Reduced:	SO3N4C20H24 (1)
Stoich.:	AB3C4D20E24 (1)
Weight, g/mol:	400.156912
ΔH_f, kcal/mol:	-89.14
Dipole, Da:	6.34
IP(EA), eV:	-9.41(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-[[(2R)-1-(cyclopentylamino)-1-oxopropan-2-yl]amino]-2-oxoethyl]-1,3-thiazol-2-yl]benzamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1CCCC1)NC(=O)CC2=CSC(=N2)NC(=O)C3=CC=CC=C3

DOS

IR

Vibrations