Geometry & MOs

Info

ID:	358847
PubChem CID:	127296718
Reduced:	SN3O5C16H29 (1)
Stoich.:	AB3C5D16E29 (1)
Weight, g/mol:	374.220557
ΔH_f, kcal/mol:	-246.26
Dipole, Da:	8.29
IP(EA), eV:	-9.51(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-propoxy-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylazepane-1-carboxamide

Drug info:

PubChemData

Smile

CCCOC1CCCN(CC1)CC(=O)NC(=O)NC2CCS(=O)(=O)C2

DOS

IR

Vibrations