Geometry & MOs

Info

ID:	75339
PubChem CID:	48423346
Reduced:	SN4O5C17H26 (1)
Stoich.:	AB4C5D17E26 (1)
Weight, g/mol:	319.156577
ΔH_f, kcal/mol:	-187.07
Dipole, Da:	3.68
IP(EA), eV:	-9.35(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(cyclopropylmethoxy)propanoyl]-N,N-dimethylpiperazine-1-sulfonamide

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)N1CCN(CC1)C(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations