Geometry & MOs

Info

ID:	371760
PubChem CID:	131271541
Reduced:	ON2C10H18 (1)
Stoich.:	AB2C10D18 (1)
Weight, g/mol:	191.094629
ΔH_f, kcal/mol:	-39.03
Dipole, Da:	3.46
IP(EA), eV:	-9.18(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-2-[4-(2-hydroxypropyl)phenyl]acetonitrile

Drug info:

PubChemData

Smile

CC(C)OC1(CCCNCC1)C#N

DOS

IR

Vibrations