Geometry & MOs

Info

ID:	258730
PubChem CID:	103156663
Reduced:	NOC5H9 (2)
Stoich.:	ABC5D9 (2)
Weight, g/mol:	218.163043
ΔH_f, kcal/mol:	-87.72
Dipole, Da:	4.0
IP(EA), eV:	-9.63(1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(1-hydroxy-2-methylpropan-2-yl)-3-methoxy-N-methylbutanamide

Drug info:

PubChemData

Smile

COC(CC(=O)NC1CC=CC1)CN

DOS

IR

Vibrations