Geometry & MOs

Info

ID:	426085
PubChem CID:	135136480
Reduced:	ClNO2C20H30 (1)
Stoich.:	ABC2D20E30 (1)
Weight, g/mol:	255.219829
ΔH_f, kcal/mol:	-99.71
Dipole, Da:	4.3
IP(EA), eV:	-8.66(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-5-(4-methyl-4-propan-2-yloxan-2-yl)pentanamide

Drug info:

PubChemData

Smile

CCN(CC[C@H](C1=CC=C(C=C1)Cl)C(=O)C(C)C)C2CCOCC2

DOS

IR

Vibrations