Geometry & MOs

Info

ID:	131787
PubChem CID:	51260701
Reduced:	SO2N4C19H26 (1)
Stoich.:	AB2C4D19E26 (1)
Weight, g/mol:	335.220892
ΔH_f, kcal/mol:	-57.27
Dipole, Da:	5.99
IP(EA), eV:	-9.02(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(3-methoxypropylamino)-2-oxoethyl]-methylamino]-N-(1-phenylethyl)propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(C)N(C)CC(=O)NC(C)C

DOS

IR

Vibrations