Geometry & MOs

Info

ID:	252608
PubChem CID:	103112636
Reduced:	N3O4C12H21 (1)
Stoich.:	A3B4C12D21 (1)
Weight, g/mol:	299.184506
ΔH_f, kcal/mol:	-188.52
Dipole, Da:	6.99
IP(EA), eV:	-9.32(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]carbamoylamino]cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC(=O)N1CCCC1C(=O)O

DOS

IR

Vibrations