Geometry & MOs

Info

ID:	53330
PubChem CID:	14710431
Reduced:	OC16H18 (1)
Stoich.:	AB16C18 (1)
Weight, g/mol:	192.11503
ΔH_f, kcal/mol:	-15.23
Dipole, Da:	3.35
IP(EA), eV:	-9.14(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-phenylmethoxypentanal

Drug info:

PubChemData

Smile

CCCCCC1=CC2=CC=CC=C2C(=C1)C=O

DOS

IR

Vibrations