Geometry & MOs

Info

ID:	424620
PubChem CID:	135123358
Reduced:	ClO3N4H27C33 (1)
Stoich.:	AB3C4D27E33 (1)
Weight, g/mol:	294.113506
ΔH_f, kcal/mol:	40.65
Dipole, Da:	4.37
IP(EA), eV:	-8.91(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-2-tert-butyl-3-methyl-4-oxo-5-phenylimidazolidine-1-carbonyl chloride

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CN2C3=C(C=C(C=C3OC4=CC(=NC=C4)Cl)C5=CC=NN5C6=CC=CC=C6)C7(C2=O)CCC7

DOS

IR

Vibrations