Geometry & MOs

Info

ID:	170632
PubChem CID:	75261865
Reduced:	O2N6C19H26 (1)
Stoich.:	A2B6C19D26 (1)
Weight, g/mol:	364.153541
ΔH_f, kcal/mol:	-32.46
Dipole, Da:	2.19
IP(EA), eV:	-9.51(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[(6-oxo-2-pyridin-2-yl-1,3-diazinan-4-yl)methyl]-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NN(C(=C1)C(=O)NCC2CC(=O)NC(N2)C3=CC=CC=N3)C

DOS

IR

Vibrations