Geometry & MOs

Info

ID:	213735
PubChem CID:	81064826
Reduced:	NOC5H7 (3)
Stoich.:	ABC5D7 (3)
Weight, g/mol:	295.189592
ΔH_f, kcal/mol:	-66.02
Dipole, Da:	2.04
IP(EA), eV:	-9.05(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-methyl-5-nitro-3-N-(2-propan-2-yloxyethyl)-1-N-propylbenzene-1,3-diamine

Drug info:

PubChemData

Smile

CCOCCN(C)CC1=C(C2=CC=CC=C2O1)C(=O)NN

DOS

IR

Vibrations