Geometry & MOs

Info

ID:	274986
PubChem CID:	103812988
Reduced:	ON2C17H26 (1)
Stoich.:	AB2C17D26 (1)
Weight, g/mol:	226.204513
ΔH_f, kcal/mol:	-54.46
Dipole, Da:	2.09
IP(EA), eV:	-9.43(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-methyl-N-[(1-methylcyclohexyl)methyl]butanamide

Drug info:

PubChemData

Smile

CC1(CCCCC1)CNC(=O)C(CN)C2=CC=CC=C2

DOS

IR

Vibrations