Geometry & MOs

Info

ID:	69147
PubChem CID:	46525518
Reduced:	O3N4C18H18 (1)
Stoich.:	A3B4C18D18 (1)
Weight, g/mol:	327.161663
ΔH_f, kcal/mol:	-62.28
Dipole, Da:	5.16
IP(EA), eV:	-8.72(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(dipropylamino)-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Drug info:

PubChemData

Smile

CC1(C(=O)N(C(=O)N1)CC(=O)NC2=CC=CC3=C2C=CN=C3)C4CC4

DOS

IR

Vibrations