Geometry & MOs

Info

ID:	323462
PubChem CID:	126674894
Reduced:	O2N5C21H27 (1)
Stoich.:	A2B5C21D27 (1)
Weight, g/mol:	436.258674
ΔH_f, kcal/mol:	-15.7
Dipole, Da:	3.37
IP(EA), eV:	-8.22(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-[(Z)-1-amino-3-methyliminoprop-1-en-2-yl]-N-[(3S)-4-phenylmethoxy-1-propan-2-ylpyrrolidin-3-yl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(COCC1=CC=CC=C1)NC(=O)C2=C(N=CC(=C2)/C(=C/N)/C=NC)N

DOS

IR

Vibrations