Geometry & MOs

Info

ID:	247304
PubChem CID:	103069875
Reduced:	OSN2C8H16 (1)
Stoich.:	ABC2D8E16 (1)
Weight, g/mol:	238.204513
ΔH_f, kcal/mol:	-14.13
Dipole, Da:	5.63
IP(EA), eV:	-8.27(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(3-ethoxypiperidin-1-yl)methyl]prop-2-enyl]cyclopropanamine

Drug info:

PubChemData

Smile

C=C(CN)CN1CCS(=O)CC1

DOS

IR

Vibrations