Geometry & MOs

Info

ID:	125922
PubChem CID:	50944080
Reduced:	N3O4H25C29 (1)
Stoich.:	A3B4C25D29 (1)
Weight, g/mol:	467.220892
ΔH_f, kcal/mol:	-71.0
Dipole, Da:	4.68
IP(EA), eV:	-9.3(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-methylphenyl)methyl]-3-[[4-(piperidine-1-carbonyl)phenyl]methyl]quinazoline-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2C3=CC=CC=C3C(=O)N(C2=O)CC4=CC=C(C=C4)C(=O)NCC5=CC=CO5

DOS

IR

Vibrations