Geometry & MOs

Info

ID:	258538
PubChem CID:	103154817
Reduced:	N3O4C14H21 (1)
Stoich.:	A3B4C14D21 (1)
Weight, g/mol:	282.155512
ΔH_f, kcal/mol:	-154.01
Dipole, Da:	5.35
IP(EA), eV:	-9.17(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-methoxy-N-[4-(trifluoromethyl)cyclohexyl]butanamide

Drug info:

PubChemData

Smile

COC(CC(=O)NC1=CC=CC=C1OCCC(=O)N)CN

DOS

IR

Vibrations