Geometry & MOs

Info

ID:	28270
PubChem CID:	826663
Reduced:	NOC16H19 (1)
Stoich.:	ABC16D19 (1)
Weight, g/mol:	244.193949
ΔH_f, kcal/mol:	7.59
Dipole, Da:	3.33
IP(EA), eV:	-8.67(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(8aS)-6,7,8,8a-tetrahydro-2H-benzo[cd]indol-1-yl]-N,N-dimethylpropan-1-amine

Drug info:

PubChemData

Smile

CN(C)CC1=CC=CC=C1COC2=CC=CC=C2

DOS

IR

Vibrations