Geometry & MOs

Info

ID:	157662
PubChem CID:	56436360
Reduced:	O2F3N3C19H26 (1)
Stoich.:	A2B3C3D19E26 (1)
Weight, g/mol:	362.220557
ΔH_f, kcal/mol:	-248.41
Dipole, Da:	4.96
IP(EA), eV:	-8.57(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 3-[[2-(4-methylpentanoylamino)acetyl]amino]-3-phenylpropanoate

Drug info:

PubChemData

Smile

CC(C)CCC(=O)NCC(=O)N1CCN(CC1)C2=CC=CC(=C2)C(F)(F)F

DOS

IR

Vibrations