Geometry & MOs

Info

ID:	258548
PubChem CID:	103154881
Reduced:	NOC7H11 (2)
Stoich.:	ABC7D11 (2)
Weight, g/mol:	251.163377
ΔH_f, kcal/mol:	-83.6
Dipole, Da:	3.98
IP(EA), eV:	-9.4(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-3-methoxy-N-methyl-N-(2-pyridin-4-ylethyl)butanamide

Drug info:

PubChemData

Smile

COC(CC(=O)NCCCC1=CC=CC=C1)CN

DOS

IR

Vibrations