Geometry & MOs

Info

ID:	282775
PubChem CID:	103938661
Reduced:	ON2C16H20 (1)
Stoich.:	AB2C16D20 (1)
Weight, g/mol:	256.157563
ΔH_f, kcal/mol:	-5.55
Dipole, Da:	4.16
IP(EA), eV:	-8.39(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[5-(N,4-dimethylanilino)pyridin-2-yl]propan-1-ol

Drug info:

PubChemData

Smile

CC[C@H](C1=NC=C(C=C1)N(C)C2=CC=CC(=C2)C)O

DOS

IR

Vibrations