Geometry & MOs

Info

ID:	293488
PubChem CID:	117391777
Reduced:	NOC17H21 (1)
Stoich.:	ABC17D21 (1)
Weight, g/mol:	255.173548
ΔH_f, kcal/mol:	-4.18
Dipole, Da:	1.32
IP(EA), eV:	-8.91(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(9-methyl-9,11-diazatetracyclo[9.2.2.02,10.03,8]pentadeca-2(10),3(8),4,6-tetraen-5-yl)ethanamine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)CCNC)OCC2=CC=CC=C2

DOS

IR

Vibrations