Geometry & MOs

Info

ID:	402988
PubChem CID:	135058196
Reduced:	ClN2O3C15H21 (1)
Stoich.:	AB2C3D15E21 (1)
Weight, g/mol:	308.146286
ΔH_f, kcal/mol:	-154.58
Dipole, Da:	6.4
IP(EA), eV:	-8.91(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-[4-chloro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methylideneamino]-N-methylmethanamine

Drug info:

PubChemData

Smile

CCOC(=O)NC1=C(C(=CC(=C1)Cl)C)NC(=O)C(C)(C)C

DOS

IR

Vibrations