Geometry & MOs

Info

ID:	197658
PubChem CID:	78984336
Reduced:	ClN2O2C16H17 (1)
Stoich.:	AB2C2D16E17 (1)
Weight, g/mol:	250.168128
ΔH_f, kcal/mol:	-47.26
Dipole, Da:	3.67
IP(EA), eV:	-8.69(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-amino-4-ethylphenyl)-4-ethoxybutanamide

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1Cl)C(=O)C2=CC(=CC(=C2)OC)N

DOS

IR

Vibrations