Geometry & MOs

Info

ID:	376986
PubChem CID:	134223021
Reduced:	NOC11H15 (1)
Stoich.:	ABC11D15 (1)
Weight, g/mol:	215.131014
ΔH_f, kcal/mol:	-36.11
Dipole, Da:	2.72
IP(EA), eV:	-9.11(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,4S,12S)-6-oxatetracyclo[10.2.1.02,11.03,8]pentadeca-2(11),3(8),9-trien-4-amine

Drug info:

PubChemData

Smile

CC1=C2COC[C@@H](C2=C(C=C1)C)N

DOS

IR

Vibrations