Geometry & MOs

Info

ID:	281181
PubChem CID:	103911284
Reduced:	N2O2C11H20 (1)
Stoich.:	A2B2C11D20 (1)
Weight, g/mol:	213.118735
ΔH_f, kcal/mol:	-103.96
Dipole, Da:	4.88
IP(EA), eV:	-9.28(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-(2-prop-2-ynylsulfanylethyl)oxan-4-amine

Drug info:

PubChemData

Smile

CC1CC(CCO1)NC2CCN(C2=O)C

DOS

IR

Vibrations