Geometry & MOs

Info

ID:	200069
PubChem CID:	79343366
Reduced:	OSN2C17H18 (1)
Stoich.:	ABC2D17E18 (1)
Weight, g/mol:	279.162314
ΔH_f, kcal/mol:	43.2
Dipole, Da:	3.53
IP(EA), eV:	-8.71(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-phenylmethoxyphenyl)prop-2-enyl]cyclopropanamine

Drug info:

PubChemData

Smile

CC(C)NCC=CC1=CC=C(O1)C2=NC3=CC=CC=C3S2

DOS

IR

Vibrations