Geometry & MOs

Info

ID:	312042
PubChem CID:	126602139
Reduced:	NO2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	349.188923
ΔH_f, kcal/mol:	-83.84
Dipole, Da:	2.66
IP(EA), eV:	-9.23(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclobutyl]oxyphenyl]acetate

Drug info:

PubChemData

Smile

COC(=O)CC1=CC=CC(=C1)CCCCN

DOS

IR

Vibrations