Geometry & MOs

Info

ID:	194827
PubChem CID:	78594472
Reduced:	N3O4C17H23 (1)
Stoich.:	A3B4C17D23 (1)
Weight, g/mol:	349.166451
ΔH_f, kcal/mol:	-106.4
Dipole, Da:	2.41
IP(EA), eV:	-8.21(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-methyl-[(4-oxo-4aH-quinazolin-2-yl)methyl]azanium

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)C(=O)NN=CC2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations