Geometry & MOs

Info

ID:	9991
PubChem CID:	95966
Reduced:	NOC7H9 (3)
Stoich.:	ABC7D9 (3)
Weight, g/mol:	369.205242
ΔH_f, kcal/mol:	-31.22
Dipole, Da:	1.98
IP(EA), eV:	-10.06(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3,5-bis(2-ethylaziridine-1-carbonyl)phenyl]-(2-ethylaziridin-1-yl)methanone

Drug info:

PubChemData

Smile

CCC1CN1C(=O)C2=CC(=CC(=C2)C(=O)N3CC3CC)C(=O)N4CC4CC

DOS

IR

Vibrations