Geometry & MOs

Info

ID:	38100
PubChem CID:	8027022
Reduced:	SO2N4C18H28 (1)
Stoich.:	AB2C4D18E28 (1)
Weight, g/mol:	380.184841
ΔH_f, kcal/mol:	-57.06
Dipole, Da:	8.19
IP(EA), eV:	-9.06(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-methoxyethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-N-(4-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CN3CCC[C@H](C3)C

DOS

IR

Vibrations