Geometry & MOs

Info

ID:	283541
PubChem CID:	103987581
Reduced:	ON2C17H26 (1)
Stoich.:	AB2C17D26 (1)
Weight, g/mol:	293.199094
ΔH_f, kcal/mol:	-36.59
Dipole, Da:	4.95
IP(EA), eV:	-8.71(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2,5-dimethoxyphenyl)-2-(oxolan-3-yl)ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CC1CCOC1)C2CCC3=C2N=CC=C3

DOS

IR

Vibrations