Geometry & MOs

Info

ID:	128748
PubChem CID:	51056996
Reduced:	NO4C23H27 (1)
Stoich.:	AB4C23D27 (1)
Weight, g/mol:	500.263509
ΔH_f, kcal/mol:	-162.02
Dipole, Da:	1.63
IP(EA), eV:	-8.7(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methylpyridin-1-ium-1-yl) N,N-dimethylcarbamate;tetraphenylboranuide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C(CC(=O)N2C(COC2=O)C3=CC=CC=C3)C(C)C)C)O

DOS

IR

Vibrations