Geometry & MOs

Info

ID:	288417
PubChem CID:	104316461
Reduced:	ClNO2C11H16 (1)
Stoich.:	ABC2D11E16 (1)
Weight, g/mol:	195.125929
ΔH_f, kcal/mol:	-91.63
Dipole, Da:	4.53
IP(EA), eV:	-9.09(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-amino-5-methylphenoxy)butan-2-ol

Drug info:

PubChemData

Smile

CC(CCOC1=C(C(=CC=C1)Cl)CN)O

DOS

IR

Vibrations