Geometry & MOs

Info

ID:	38488
PubChem CID:	8136889
Reduced:	ClN3O3C18H24 (1)
Stoich.:	AB3C3D18E24 (1)
Weight, g/mol:	355.153206
ΔH_f, kcal/mol:	-119.92
Dipole, Da:	5.98
IP(EA), eV:	-9.65(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-[[2-(cyclopropylamino)-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C[C@H](C(=O)NCC(=O)NC1CC1)NC(=O)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations