Geometry & MOs

Info

ID:	343946
PubChem CID:	127267122
Reduced:	ON5C15H19 (1)
Stoich.:	AB5C15D19 (1)
Weight, g/mol:	301.140197
ΔH_f, kcal/mol:	24.66
Dipole, Da:	3.6
IP(EA), eV:	-8.74(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(dimethylamino)methyl]-N-[2-(trifluoromethyl)phenyl]azetidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)N2CC(C2)N3C(=NC(=N3)C)C

DOS

IR

Vibrations