Geometry & MOs

Info

ID:	266125
PubChem CID:	103558466
Reduced:	NO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	327.08339
ΔH_f, kcal/mol:	-84.95
Dipole, Da:	1.0
IP(EA), eV:	-9.26(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(CN)C(CC2(CCC2)OC)O

DOS

IR

Vibrations