Geometry & MOs

Info

ID:	243443
PubChem CID:	99222798
Reduced:	N3O4C19H25 (1)
Stoich.:	A3B4C19D25 (1)
Weight, g/mol:	400.156912
ΔH_f, kcal/mol:	-175.3
Dipole, Da:	5.12
IP(EA), eV:	-8.64(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-[[(2S)-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)COC2=CC3=C(C=C2)NC(=O)CC3

DOS

IR

Vibrations