Geometry & MOs

Info

ID:	267220
PubChem CID:	103581404
Reduced:	NO2C18H29 (1)
Stoich.:	AB2C18D29 (1)
Weight, g/mol:	261.172879
ΔH_f, kcal/mol:	-106.8
Dipole, Da:	2.89
IP(EA), eV:	-9.14(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-2,3-dimethyloxolan-3-amine

Drug info:

PubChemData

Smile

CC1C(CCO1)(C)NCC(C2=CC=C(C=C2)CC(C)C)O

DOS

IR

Vibrations