Geometry & MOs

Info

ID:	282437
PubChem CID:	103926986
Reduced:	N2O3C12H22 (1)
Stoich.:	A2B3C12D22 (1)
Weight, g/mol:	275.126991
ΔH_f, kcal/mol:	-173.5
Dipole, Da:	6.29
IP(EA), eV:	-9.92(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(3-cyanophenyl)carbamoylamino]-3,3-dimethylbutanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)[C@H](C(=O)O)NC(=O)NC1CCCC1

DOS

IR

Vibrations