Geometry & MOs

Info

ID:	373910
PubChem CID:	131321229
Reduced:	NO4C11H13 (1)
Stoich.:	AB4C11D13 (1)
Weight, g/mol:	218.105528
ΔH_f, kcal/mol:	-149.06
Dipole, Da:	0.73
IP(EA), eV:	-9.03(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1R)-1-amino-3-hydroxypropyl]quinolin-3-ol

Drug info:

PubChemData

Smile

COC(=O)C1=C2[C@@H](CCOC2=C(C=C1)O)N

DOS

IR

Vibrations