Geometry & MOs

Info

ID:	316064
PubChem CID:	126629858
Reduced:	N5O6C31H49 (1)
Stoich.:	A5B6C31D49 (1)
Weight, g/mol:	171.125929
ΔH_f, kcal/mol:	-267.85
Dipole, Da:	10.5
IP(EA), eV:	-8.85(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R)-3-methoxy-2-methylhept-6-enamide

Drug info:

PubChemData

Smile

CC(C)[C@H](C1=CC(=CC=C1)OCC=C)NC(=O)C2CCCN(N2)C(=O)C(C)NC(=O)[C@H](C(C)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations