Geometry & MOs

Info

ID:	284436
PubChem CID:	104046535
Reduced:	N3O3C11H17 (1)
Stoich.:	A3B3C11D17 (1)
Weight, g/mol:	228.147393
ΔH_f, kcal/mol:	-54.51
Dipole, Da:	2.52
IP(EA), eV:	-9.57(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(1-amino-3-methyl-1-oxobutan-2-yl)amino]-2-cyclopropylacetate

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CCNC(C2CC2)C(=O)OC

DOS

IR

Vibrations