Geometry & MOs

Info

ID:	223518
PubChem CID:	85335161
Reduced:	O8C21H24 (1)
Stoich.:	A8B21C24 (1)
Weight, g/mol:	404.213364
ΔH_f, kcal/mol:	-294.31
Dipole, Da:	7.18
IP(EA), eV:	-8.86(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-hydroxy-4-[2-(2-methylpropyl)pyrrolidin-1-yl]butyl]naphthalene-1-sulfonamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C=CC2=CC(=CC(=C2)OC3C(C(OC(C3O)O)CO)O)O

DOS

IR

Vibrations