Geometry & MOs

Info

ID:	130050
PubChem CID:	51074759
Reduced:	OSN6C14H18 (1)
Stoich.:	ABC6D14E18 (1)
Weight, g/mol:	342.115047
ΔH_f, kcal/mol:	57.14
Dipole, Da:	4.35
IP(EA), eV:	-9.4(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2-cyclopropylquinazolin-4-yl)sulfanylpropanoyl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CC(C)C(C)(C#N)NC(=O)C(C)SC1=NN2C=CC=NC2=N1

DOS

IR

Vibrations