Geometry & MOs

Info

ID:	429676
PubChem CID:	135169727
Reduced:	ClN4C10H13 (1)
Stoich.:	AB4C10D13 (1)
Weight, g/mol:	368.113488
ΔH_f, kcal/mol:	50.61
Dipole, Da:	4.24
IP(EA), eV:	-7.55(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-[3,5-bis(trifluoromethyl)piperidin-1-yl]-2,2-difluoroethenyl]morpholine

Drug info:

PubChemData

Smile

CC1C(=CC(=C(N1)C2=NN(C=C2)C)Cl)N

DOS

IR

Vibrations