Geometry & MOs

Info

ID:	265874
PubChem CID:	103555936
Reduced:	NO3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	272.037085
ΔH_f, kcal/mol:	-110.98
Dipole, Da:	2.31
IP(EA), eV:	-9.18(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,5-dichlorophenyl)-2-(1-methoxycyclobutyl)ethanone

Drug info:

PubChemData

Smile

COC1(CCC1)CC(=O)C2=CC3=C(C=C2)NC(=O)CCC3

DOS

IR

Vibrations