Geometry & MOs

Info

ID:	143444
PubChem CID:	53210193
Reduced:	O2N4H16C17 (1)
Stoich.:	A2B4C16D17 (1)
Weight, g/mol:	352.153541
ΔH_f, kcal/mol:	21.56
Dipole, Da:	5.61
IP(EA), eV:	-8.6(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-ethoxyphenyl)methyl]-11-methyl-10-oxa-3,6,8-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,7,11-tetraene-12-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C2=C(O1)N=CN3C2=NCC3)C(=O)N(C)C4=CC=CC=C4

DOS

IR

Vibrations