Geometry & MOs

Info

ID:	236276
PubChem CID:	92712175
Reduced:	SN4O4H26C28 (1)
Stoich.:	AB4C4D26E28 (1)
Weight, g/mol:	514.167477
ΔH_f, kcal/mol:	-42.74
Dipole, Da:	5.39
IP(EA), eV:	-8.51(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(2R)-2-benzyl-3-oxo-2H-imidazo[1,2-c]quinazolin-5-yl]sulfanyl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1OC)CNC(=O)CSC2=NC3=CC=CC=C3C4=N[C@H](C(=O)N42)CC5=CC=CC=C5

DOS

IR

Vibrations