Geometry & MOs

Info

ID:	189224
PubChem CID:	77828917
Reduced:	N2F3O4C31H35 (1)
Stoich.:	A2B3C4D31E35 (1)
Weight, g/mol:	204.162649
ΔH_f, kcal/mol:	-271.35
Dipole, Da:	6.25
IP(EA), eV:	-9.05(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(3-methyl-6-methylidene-1,2,3,4-tetrahydroquinolizin-1-yl)methanamine

Drug info:

PubChemData

Smile

CC(=O)OC1=CC=CC(=C1)C23CCCCC2CN(C(C3)NC(=O)C(=CC4=CC=CC=C4)OC(F)(F)F)CC5CC5

DOS

IR

Vibrations