Geometry & MOs

Info

ID:	221178
PubChem CID:	85257141
Reduced:	ClNOC17H22 (1)
Stoich.:	ABCD17E22 (1)
Weight, g/mol:	291.99603
ΔH_f, kcal/mol:	-37.29
Dipole, Da:	4.17
IP(EA), eV:	-9.66(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-iodo-4-methoxy-2-(1-methoxyethyl)benzene

Drug info:

PubChemData

Smile

CC1(C2CCC(C1C2)CNC(=O)C3=CC=CC=C3Cl)C

DOS

IR

Vibrations