Geometry & MOs

Info

ID:	303047
PubChem CID:	124489144
Reduced:	NO2C12H17 (1)
Stoich.:	AB2C12D17 (1)
Weight, g/mol:	165.115364
ΔH_f, kcal/mol:	-65.97
Dipole, Da:	3.64
IP(EA), eV:	-9.39(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-cyclopropyl-3-(furan-2-yl)propan-1-amine

Drug info:

PubChemData

Smile

C1COC[C@@]1(CO)NCC2=CC=CC=C2

DOS

IR

Vibrations