Geometry & MOs

Info

ID:	377030
PubChem CID:	134223065
Reduced:	NC18H33 (1)
Stoich.:	AB18C33 (1)
Weight, g/mol:	191.131014
ΔH_f, kcal/mol:	-28.31
Dipole, Da:	2.56
IP(EA), eV:	-8.92(1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-N-propyl-3,4-dihydro-1H-isochromen-4-amine

Drug info:

PubChemData

Smile

CCCCCCCNCCC1CCC(=C)CCC1=C

DOS

IR

Vibrations