Geometry & MOs

Info

ID:	170604
PubChem CID:	75258626
Reduced:	N2O3C17H22 (1)
Stoich.:	A2B3C17D22 (1)
Weight, g/mol:	368.184841
ΔH_f, kcal/mol:	-81.76
Dipole, Da:	3.91
IP(EA), eV:	-9.51(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-[(2-methoxyphenyl)methyl]-6-oxo-1,3-diazinan-4-yl]methyl]-5-methylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=O)C(C=C1)C(=O)N(CC2=CC=CO2)C(C)C(C)C

DOS

IR

Vibrations