Geometry & MOs

Info

ID:	266132
PubChem CID:	103558484
Reduced:	NO2C11H23 (1)
Stoich.:	AB2C11D23 (1)
Weight, g/mol:	293.199094
ΔH_f, kcal/mol:	-112.84
Dipole, Da:	4.82
IP(EA), eV:	-9.54(2.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-(4-ethoxyphenyl)-1-(1-methoxycyclobutyl)butan-2-ol

Drug info:

PubChemData

Smile

CCC(CN)C(CC1(CCC1)OC)O

DOS

IR

Vibrations