Geometry & MOs

Info

ID:	39247
PubChem CID:	8139975
Reduced:	N2O2C19H24 (1)
Stoich.:	A2B2C19D24 (1)
Weight, g/mol:	381.151098
ΔH_f, kcal/mol:	-39.12
Dipole, Da:	4.8
IP(EA), eV:	-8.84(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[3-(3,5-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N,N-dimethylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCC(=O)NCC2=CC=CC=C2CN(C)C

DOS

IR

Vibrations