Geometry & MOs

Info

ID:	411405
PubChem CID:	135084228
Reduced:	NO3C12H23 (1)
Stoich.:	AB3C12D23 (1)
Weight, g/mol:	222.16198
ΔH_f, kcal/mol:	-168.1
Dipole, Da:	2.59
IP(EA), eV:	-9.89(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-4-(ethoxymethoxymethyl)benzene

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCCC/C=C/CO

DOS

IR

Vibrations