Geometry & MOs

Info

ID:	130016
PubChem CID:	51074618
Reduced:	N3O3C17H25 (1)
Stoich.:	A3B3C17D25 (1)
Weight, g/mol:	325.109627
ΔH_f, kcal/mol:	-95.45
Dipole, Da:	2.61
IP(EA), eV:	-8.92(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-acetylphenyl)sulfonyl-N-methylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCN1CCOC2=CC=CC=C2)C(=O)N3CCOCC3

DOS

IR

Vibrations