Geometry & MOs

Info

ID:	191510
PubChem CID:	78155092
Reduced:	O3N4C22H24 (1)
Stoich.:	A3B4C22D24 (1)
Weight, g/mol:	423.179421
ΔH_f, kcal/mol:	-48.34
Dipole, Da:	2.6
IP(EA), eV:	-8.55(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenyl 2-amino-5-[[3-(1H-indol-3-yl)-1-methoxy-1-oxopropan-2-yl]amino]-5-oxopentanoate

Drug info:

PubChemData

Smile

CC1CN(CC(N1)C)C2=CN3C(=NC(=CC3=O)C4=CC5=C(C=C4)OCCO5)C=C2

DOS

IR

Vibrations