Geometry & MOs

Info

ID:	189205
PubChem CID:	77826325
Reduced:	ClNOC22H34 (1)
Stoich.:	ABCD22E34 (1)
Weight, g/mol:	327.154984
ΔH_f, kcal/mol:	-71.69
Dipole, Da:	4.88
IP(EA), eV:	-9.39(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCC(CCCC=CC(=O)CC(C)(C)C)C(CC1=CC(=CC=C1)Cl)N

DOS

IR

Vibrations