Geometry & MOs

Info

ID:	129876
PubChem CID:	51074122
Reduced:	SN3O4C16H17 (1)
Stoich.:	AB3C4D16E17 (1)
Weight, g/mol:	305.162708
ΔH_f, kcal/mol:	-86.87
Dipole, Da:	4.47
IP(EA), eV:	-9.09(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-methoxyethyl)cyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC2=NC(=NC(=C12)OC)COC)C(=O)NCC3=CC=CO3

DOS

IR

Vibrations