Geometry & MOs

Info

ID:	185717
PubChem CID:	77337929
Reduced:	ClO3N8C32H37 (1)
Stoich.:	AB3C8D32E37 (1)
Weight, g/mol:	337.131939
ΔH_f, kcal/mol:	69.8
Dipole, Da:	10.39
IP(EA), eV:	-8.48(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCCC1=NC(=C(N1CC2=CC(=C(C=C2)C3=CC=CC=C3)C4NNNN4)C(=O)C5=[N+](C(=CC=C5)C(=O)N(CC)CC)[O-])Cl

DOS

IR

Vibrations