Geometry & MOs

Info

ID:	163856
PubChem CID:	74380557
Reduced:	NSO3C22H37 (1)
Stoich.:	ABC3D22E37 (1)
Weight, g/mol:	362.174276
ΔH_f, kcal/mol:	-157.41
Dipole, Da:	1.14
IP(EA), eV:	-9.78(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(2-amino-2-oxoethyl)-3,5-dimethylphenyl]methylideneamino]-2-(1H-indol-3-yl)acetamide

Drug info:

PubChemData

Smile

CCCCCCC1C(O1)CCCCC=CCCCCCC2C(=O)NC(=O)S2

DOS

IR

Vibrations