Geometry & MOs

Info

ID:	353960
PubChem CID:	127285600
Reduced:	SO3N5C17H29 (1)
Stoich.:	AB3C5D17E29 (1)
Weight, g/mol:	393.183461
ΔH_f, kcal/mol:	-95.48
Dipole, Da:	5.12
IP(EA), eV:	-8.61(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-(2-oxopyrrolidin-1-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C(C)N1CCOCC1)NC(=O)NC2=NC(=CS2)CN3CCOCC3

DOS

IR

Vibrations