Geometry & MOs

Info

ID:	213153
PubChem CID:	81063038
Reduced:	FN2O2C16H25 (1)
Stoich.:	AB2C2D16E25 (1)
Weight, g/mol:	295.189592
ΔH_f, kcal/mol:	-134.0
Dipole, Da:	3.84
IP(EA), eV:	-8.43(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]-2-nitroaniline

Drug info:

PubChemData

Smile

CCCNC1=C(C=CC=C1F)C(=O)N(C)CCOC(C)C

DOS

IR

Vibrations