Geometry & MOs

Info

ID:	353894
PubChem CID:	127285534
Reduced:	SO3N4C14H24 (1)
Stoich.:	AB3C4D14E24 (1)
Weight, g/mol:	345.208613
ΔH_f, kcal/mol:	-91.06
Dipole, Da:	8.65
IP(EA), eV:	-8.45(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-pyrrolidin-1-yloxan-4-yl)methyl]azepane-1-sulfonamide

Drug info:

PubChemData

Smile

CN1C=C(C=N1)S(=O)(=O)NCC2(CCOCC2)N3CCCC3

DOS

IR

Vibrations