Geometry & MOs

Info

ID:	395161
PubChem CID:	135024809
Reduced:	SiN6O7C31H58 (1)
Stoich.:	AB6C7D31E58 (1)
Weight, g/mol:	372.179755
ΔH_f, kcal/mol:	-210.53
Dipole, Da:	23.21
IP(EA), eV:	-4.63(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(dimethylamino)-1,3-dimethyl-5-(4-methylphenyl)-6-nitro-4a,5,6,7-tetrahydroquinazoline-2,4-dione

Drug info:

PubChemData

Smile

CCO[Si](CCCNC1=C(C(=O)C1=O)NCCC[N+](C)(C)CCCNC2=C(C(=O)C2=O)NCCC[N+](C)(C)C)(OCC)OCC

DOS

IR

Vibrations