Geometry & MOs

Info

ID:	344381
PubChem CID:	127267557
Reduced:	N3O4C17H23 (1)
Stoich.:	A3B4C17D23 (1)
Weight, g/mol:	287.120068
ΔH_f, kcal/mol:	-158.61
Dipole, Da:	1.96
IP(EA), eV:	-9.71(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(dimethylamino)methyl]-N-(3-fluorophenyl)azetidine-1-carboxamide;hydrochloride

Drug info:

PubChemData

Smile

COC(=O)C1=CC(=O)N(C=N1)CC(=O)N2CCCC3C2CCCC3

DOS

IR

Vibrations