Geometry & MOs

Info

ID:	344027
PubChem CID:	127267203
Reduced:	FNOC4H4 (3)
Stoich.:	ABCD4E4 (3)
Weight, g/mol:	272.113648
ΔH_f, kcal/mol:	-176.4
Dipole, Da:	7.21
IP(EA), eV:	-9.92(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-dimethylphenyl)-3-(trifluoromethyl)azetidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)N2CC(C2)C(F)(F)F

DOS

IR

Vibrations