Geometry & MOs

Info

ID:	262215
PubChem CID:	103277238
Reduced:	ON2F3C12H19 (1)
Stoich.:	AB2C3D12E19 (1)
Weight, g/mol:	307.133907
ΔH_f, kcal/mol:	-212.71
Dipole, Da:	1.97
IP(EA), eV:	-9.08(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(3-chloroanilino)-2-(3,5-dimethylcyclohex-3-en-1-yl)acetate

Drug info:

PubChemData

Smile

CC1CC(CC(=C1)C)C(C(=O)N)NCC(F)(F)F

DOS

IR

Vibrations