Geometry & MOs

Info

ID:	187380
PubChem CID:	77567317
Reduced:	SiO5C23H44 (1)
Stoich.:	AB5C23D44 (1)
Weight, g/mol:	396.252526
ΔH_f, kcal/mol:	-349.33
Dipole, Da:	3.37
IP(EA), eV:	-9.36(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-4-oxoquinazolin-3-yl]-2-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)acetamide

Drug info:

PubChemData

Smile

CCCC(CCC1CCC2C(CC(C2CO[Si](C)(C)CC(C)C)O)OC1)C(=O)O

DOS

IR

Vibrations