Geometry & MOs

Info

ID:	169283
PubChem CID:	75084411
Reduced:	F3N4O6C17H23 (1)
Stoich.:	A3B4C6D17E23 (1)
Weight, g/mol:	322.164105
ΔH_f, kcal/mol:	-384.14
Dipole, Da:	11.28
IP(EA), eV:	-10.17(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 7-ethyl-4,10-dimethyl-5-methylimino-9,11-dioxo-4,6,10-triazatricyclo[6.3.0.02,6]undecane-7-carboxylate

Drug info:

PubChemData

Smile

CCC1(C2C(C3N1C(=NC)N(C3)C)C(=O)N(C2=O)C)C(=O)OC.C(=O)(C(F)(F)F)O

DOS

IR

Vibrations