Geometry & MOs

Info

ID:	192459
PubChem CID:	78271457
Reduced:	N2S2O5C20H20 (1)
Stoich.:	A2B2C5D20E20 (1)
Weight, g/mol:	398.223238
ΔH_f, kcal/mol:	-140.93
Dipole, Da:	7.14
IP(EA), eV:	-9.27(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-[(9-ethylcarbazol-3-yl)amino]-2-oxoethyl]-(1,2,3,4-tetrahydronaphthalen-1-yl)azanium

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C2C(=NC(=NC2=O)COC(=O)C3=CC4=C(S3)CCCC4)S1)C

DOS

IR

Vibrations