Geometry & MOs

Info

ID:	221492
PubChem CID:	85273776
Reduced:	NO4H17C18 (1)
Stoich.:	AB4C17D18 (1)
Weight, g/mol:	311.148121
ΔH_f, kcal/mol:	-109.11
Dipole, Da:	3.92
IP(EA), eV:	-9.64(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-(3-isocyanato-2-methylpropanoyl)-1-methyl-2-oxoimidazolidine-4-carboxylate

Drug info:

PubChemData

Smile

COC(=O)CN1C(OC(C1=O)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations