Geometry & MOs

Info

ID:	393630
PubChem CID:	135021317
Reduced:	N5O6C33H49 (1)
Stoich.:	A5B6C33D49 (1)
Weight, g/mol:	391.157229
ΔH_f, kcal/mol:	-156.59
Dipole, Da:	12.88
IP(EA), eV:	-7.66(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1,1-dimethyl-3-(4-nitrophenyl)inden-2-yl]naphthalene

Drug info:

PubChemData

Smile

CN(C)CCCNC1=C(C(=O)C1=O)NCCCCCCCCCCCCNC2=C(C(=O)C2=O)NCCC3=CC(=C(C=C3)O)O

DOS

IR

Vibrations