Geometry & MOs

Info

ID:	445119
PubChem CID:	135264601
Reduced:	ON4C33H42 (1)
Stoich.:	AB4C33D42 (1)
Weight, g/mol:	387.190654
ΔH_f, kcal/mol:	107.6
Dipole, Da:	8.05
IP(EA), eV:	-8.72(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(dimethylamino)-N-[[3-(2,6-dioxopiperidin-3-yl)-2-methyl-4-oxo-4a,8a-dihydroquinazolin-5-yl]methyl]acetamide

Drug info:

PubChemData

Smile

C1CCCC(CCC1)CN2C3=C(C4=CC=CC=C4N(CC5=CC=CC=C53)C(=O)CC6CCCCCC6)N=N2

DOS

IR

Vibrations