Geometry & MOs

Info

ID:	342867
PubChem CID:	127266030
Reduced:	ON2C6H6 (2)
Stoich.:	AB2C6D6 (2)
Weight, g/mol:	259.157229
ΔH_f, kcal/mol:	-11.27
Dipole, Da:	6.16
IP(EA), eV:	-8.71(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,2-dimethyl-3-phenylmethoxycyclobutyl)prop-2-enamide

Drug info:

PubChemData

Smile

C=CC(=O)NCC(=O)NC1=CC2=C(C=C1)C=NN2

DOS

IR

Vibrations