Geometry & MOs

Info

ID:	397224
PubChem CID:	135029909
Reduced:	Cl2N2O3H12C19 (1)
Stoich.:	A2B2C3D12E19 (1)
Weight, g/mol:	292.189926
ΔH_f, kcal/mol:	17.14
Dipole, Da:	8.67
IP(EA), eV:	-9.65(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-dibutyl-3-(4-nitrophenyl)guanidine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations