Geometry & MOs

Info

ID:	182495
PubChem CID:	76894257
Reduced:	N2O2C15H24 (1)
Stoich.:	A2B2C15D24 (1)
Weight, g/mol:	258.176585
ΔH_f, kcal/mol:	-92.87
Dipole, Da:	2.18
IP(EA), eV:	-8.81(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-(cyclohexylmethyl)-N-methyl-4-methylsulfanylbutanamide

Drug info:

PubChemData

Smile

CC(C)CCN(C)C(=O)C(CC1=CC=C(C=C1)O)N

DOS

IR

Vibrations