Geometry & MOs

Info

ID:	356107
PubChem CID:	127291143
Reduced:	SN3O4C18H27 (1)
Stoich.:	AB3C4D18E27 (1)
Weight, g/mol:	340.211055
ΔH_f, kcal/mol:	-159.11
Dipole, Da:	5.28
IP(EA), eV:	-9.16(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-morpholin-4-ylacetyl)-N-(oxan-3-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NC3CCCOC3)C

DOS

IR

Vibrations