Geometry & MOs

Info

ID:	163191
PubChem CID:	57654413
Reduced:	RbSN5O8C35H48 (1)
Stoich.:	ABC5D8E35F48 (1)
Weight, g/mol:	135.104799
ΔH_f, kcal/mol:	-290.81
Dipole, Da:	28.13
IP(EA), eV:	-6.48(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

(4-ethylphenyl)methylazanium

Drug info:

PubChemData

Smile

CC(=O)CCCCCNC(=O)CSC1CC(=O)N(C1=O)CC(=O)NCCOCC(=O)[N-]CC2=CC=C(C=C2)CC(=O)C3=C(CCCC3)NC.[Rb+]

DOS

IR

Vibrations