Geometry & MOs

Info

ID:	448568
PubChem CID:	135291937
Reduced:	N3O3C11H22 (2)
Stoich.:	A3B3C11D22 (2)
Weight, g/mol:	300.185608
ΔH_f, kcal/mol:	-317.98
Dipole, Da:	4.03
IP(EA), eV:	-8.48(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-acetyl-2,4-diethyl-2,4-dimethylcyclooctane-1-carbonyl chloride

Drug info:

PubChemData

Smile

CC(C)(CCC(=O)NC(CCCCNC(=O)CCC(=O)N)C(=O)N)OCC(C)(C)OCCNN

DOS

IR

Vibrations