Geometry & MOs

Info

ID:	205208
PubChem CID:	80068881
Reduced:	ON2C11H26 (1)
Stoich.:	AB2C11D26 (1)
Weight, g/mol:	259.097521
ΔH_f, kcal/mol:	-80.18
Dipole, Da:	4.58
IP(EA), eV:	-8.62(2.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-chloro-2,5-dimethoxyanilino)butan-2-ol

Drug info:

PubChemData

Smile

CC(C(C)O)NCC(C)(C)CN(C)C

DOS

IR

Vibrations