Geometry & MOs

Info

ID:	309176
PubChem CID:	126539560
Reduced:	NF2C21H25 (1)
Stoich.:	AB2C21D25 (1)
Weight, g/mol:	295.233371
ΔH_f, kcal/mol:	-78.12
Dipole, Da:	1.92
IP(EA), eV:	-9.24(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(9R)-7-ethyl-9-ethylsulfanyl-4,9-dimethyl-6-tricyclo[6.2.0.02,5]decanyl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CCC(C1CCC(CC1)C2=CC=C(C=C2)C3=CC(=C(C=C3)F)F)N

DOS

IR

Vibrations