Geometry & MOs

Info

ID:	282287
PubChem CID:	103921383
Reduced:	NC7H9 (2)
Stoich.:	AB7C9 (2)
Weight, g/mol:	309.17625
ΔH_f, kcal/mol:	55.69
Dipole, Da:	5.39
IP(EA), eV:	-9.09(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-1-thiophen-3-ylethanol

Drug info:

PubChemData

Smile

CCC1CC1NC(C)C2=CC=CC(=C2)C#N

DOS

IR

Vibrations