Geometry & MOs

Info

ID:	137366
PubChem CID:	52199007
Reduced:	O2N3C21H25 (1)
Stoich.:	A2B3C21D25 (1)
Weight, g/mol:	275.163377
ΔH_f, kcal/mol:	-44.11
Dipole, Da:	7.19
IP(EA), eV:	-8.58(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[[(2R)-butan-2-yl]carbamoylamino]phenyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

C[C@H](CCC1=CC=CC=C1)NC(=O)NC2=CC=CC(=C2)NC(=O)C3CC3

DOS

IR

Vibrations