Geometry & MOs

Info

ID:	63749
PubChem CID:	26759090
Reduced:	N2O5C22H26 (1)
Stoich.:	A2B5C22D26 (1)
Weight, g/mol:	364.163436
ΔH_f, kcal/mol:	-149.31
Dipole, Da:	0.98
IP(EA), eV:	-8.39(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(cyclopentylcarbamoylamino)-1-oxopropan-2-yl] 3,4-dimethoxybenzoate

Drug info:

PubChemData

Smile

C[C@H](C(=O)N1CCN(CC1)C2=CC=CC=C2)OC(=O)C3=CC(=C(C=C3)OC)OC

DOS

IR

Vibrations