Geometry & MOs

Info

ID:	283870
PubChem CID:	104014466
Reduced:	SN2O3C15H24 (1)
Stoich.:	AB2C3D15E24 (1)
Weight, g/mol:	255.162314
ΔH_f, kcal/mol:	-133.57
Dipole, Da:	7.89
IP(EA), eV:	-9.28(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,5-dimethylpyridin-2-yl)-(4-propylphenyl)methanol

Drug info:

PubChemData

Smile

CC1=CC(=C(N=C1)C(CC2CCCN(C2)S(=O)(=O)C)O)C

DOS

IR

Vibrations