Geometry & MOs

Info

ID:	445342
PubChem CID:	135266284
Reduced:	ClON3C23H24 (1)
Stoich.:	ABC3D23E24 (1)
Weight, g/mol:	267.147058
ΔH_f, kcal/mol:	26.13
Dipole, Da:	2.4
IP(EA), eV:	-8.12(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(2,4-dimethylphenyl)-hydroxymethoxy]carbamate

Drug info:

PubChemData

Smile

CC1=C(C(=C(N1C)C2=CC=C(C=C2)Cl)C3=CC(=CC=C3)N4CCNCC4)C=O

DOS

IR

Vibrations