Geometry & MOs

Info

ID:	51557
PubChem CID:	12014248
Reduced:	ClNO3H10C12 (1)
Stoich.:	ABC3D10E12 (1)
Weight, g/mol:	367.080435
ΔH_f, kcal/mol:	-107.71
Dipole, Da:	8.93
IP(EA), eV:	-9.24(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 6-methyl-4-oxo-3-oxa-11,14,15-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),5,8,12(17),13,15-heptaene-13,16-dicarboxylate

Drug info:

PubChemData

Smile

CC1=CC(=O)OC2=C1C=CC(=C2C(=O)CCl)N

DOS

IR

Vibrations