Geometry & MOs

Info

ID:	31836
PubChem CID:	3720779
Reduced:	O2N3C13H16 (2)
Stoich.:	A2B3C13D16 (2)
Weight, g/mol:	274.152872
ΔH_f, kcal/mol:	-28.88
Dipole, Da:	4.93
IP(EA), eV:	-8.23(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-[(2-ethoxy-2-oxoethyl)carbamoylamino]hexanoate

Drug info:

PubChemData

Smile

CC(=NCCN=C(C)C(=NNC1=CC=C(C=C1)OC)C(=O)C)C(=NNC2=CC=C(C=C2)OC)C(=O)C

DOS

IR

Vibrations