Geometry & MOs

Info

ID:	256409
PubChem CID:	103139064
Reduced:	NO2H13C18 (1)
Stoich.:	AB2C13D18 (1)
Weight, g/mol:	279.219829
ΔH_f, kcal/mol:	13.2
Dipole, Da:	4.18
IP(EA), eV:	-9.32(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-cyclopropyl-3-[(5-methyloxolan-2-yl)methyl]oxolan-3-yl]methyl]cyclopropanamine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CO2)C(C3=CC=CC4=C3C=NC=C4)O

DOS

IR

Vibrations