Geometry & MOs

Info

ID:	46193
PubChem CID:	10522968
Reduced:	ClO2N4H15C19 (1)
Stoich.:	AB2C4D15E19 (1)
Weight, g/mol:	366.0678
ΔH_f, kcal/mol:	90.43
Dipole, Da:	5.95
IP(EA), eV:	-8.95(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

triethyl 5-bromopentane-1,1,1-tricarboxylate

Drug info:

PubChemData

Smile

CC1=NN(C2=C1CCC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)Cl

DOS

IR

Vibrations