Geometry & MOs

Info

ID:	344168
PubChem CID:	127267344
Reduced:	O3N4C15H20 (1)
Stoich.:	A3B4C15D20 (1)
Weight, g/mol:	317.119798
ΔH_f, kcal/mol:	-108.54
Dipole, Da:	8.47
IP(EA), eV:	-9.74(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-methoxyphenyl)methyl]-N-(1,3-thiazol-2-ylmethyl)azetidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1CCCN(CC1)C(=O)CCN2C=C(C(=O)NC2=O)C#N

DOS

IR

Vibrations