Geometry & MOs

Info

ID:	203072
PubChem CID:	79775035
Reduced:	SO2N4C13H18 (1)
Stoich.:	AB2C4D13E18 (1)
Weight, g/mol:	236.152478
ΔH_f, kcal/mol:	-45.55
Dipole, Da:	5.97
IP(EA), eV:	-8.66(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(oxolan-3-ylmethoxy)pyridin-2-yl]methyl]ethanamine

Drug info:

PubChemData

Smile

CCCNC1=NC=C(S1)CN2C(=O)C=C(N=C2OC)C

DOS

IR

Vibrations