Geometry & MOs

Info

ID:	209798
PubChem CID:	80723834
Reduced:	NOSC15H19 (1)
Stoich.:	ABCD15E19 (1)
Weight, g/mol:	240.111007
ΔH_f, kcal/mol:	-11.7
Dipole, Da:	1.37
IP(EA), eV:	-8.61(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-ethoxy-5-nitroanilino)propan-1-ol

Drug info:

PubChemData

Smile

CC1(CCCS1)CNCC2=COC3=CC=CC=C32

DOS

IR

Vibrations