Geometry & MOs

Info

ID:	245179
PubChem CID:	99437785
Reduced:	SO2N6C20H22 (1)
Stoich.:	AB2C6D20E22 (1)
Weight, g/mol:	431.19574
ΔH_f, kcal/mol:	5.55
Dipole, Da:	1.23
IP(EA), eV:	-8.72(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-methylphenyl)carbamoylamino]-N-[[3-(phenylcarbamoylamino)phenyl]methyl]acetamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NCC1=CC(=CC=C1)NC(=O)NC2=CC=CC=C2)SC3=NN=CN3C

DOS

IR

Vibrations