Geometry & MOs

Info

ID:	235217
PubChem CID:	92304232
Reduced:	FON2C22H25 (1)
Stoich.:	ABC2D22E25 (1)
Weight, g/mol:	415.189592
ΔH_f, kcal/mol:	-54.19
Dipole, Da:	6.28
IP(EA), eV:	-8.55(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(2,4-dimethoxyphenyl)-3-(1H-indol-3-yl)-N-(pyridin-4-ylmethyl)propanamide

Drug info:

PubChemData

Smile

CCCCNC(=O)C[C@H](C1=CC(=CC=C1)F)C2=CN(C3=CC=CC=C32)C

DOS

IR

Vibrations