Geometry & MOs

Info

ID:	431554
PubChem CID:	135171642
Reduced:	ClON2C10H15 (1)
Stoich.:	ABC2D10E15 (1)
Weight, g/mol:	211.193614
ΔH_f, kcal/mol:	5.6
Dipole, Da:	3.74
IP(EA), eV:	-8.76(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-but-1-enyl]-N-(2-methylpropyl)oxan-4-amine

Drug info:

PubChemData

Smile

CC(NC(=C)/C=C\C(=NC=C)Cl)OC

DOS

IR

Vibrations