Geometry & MOs

Info

ID:	285368
PubChem CID:	104102826
Reduced:	N2O2C11H14 (1)
Stoich.:	A2B2C11D14 (1)
Weight, g/mol:	200.152478
ΔH_f, kcal/mol:	-25.09
Dipole, Da:	2.88
IP(EA), eV:	-9.22(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(aminomethyl)-3-methyl-1-(oxazinan-2-yl)butan-1-one

Drug info:

PubChemData

Smile

C1CN(OC1)C(=O)C2=CC=C(C=C2)CN

DOS

IR

Vibrations