Geometry & MOs

Info

ID:	440688
PubChem CID:	135230967
Reduced:	N2O2F3H25C28 (1)
Stoich.:	A2B2C3D25E28 (1)
Weight, g/mol:	160.132411
ΔH_f, kcal/mol:	-152.08
Dipole, Da:	4.19
IP(EA), eV:	-8.28(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3S)-3-amino-4-hydroxypentyl]guanidine

Drug info:

PubChemData

Smile

CC(C)(CN1CCC2=C(C1C3=C(C=C(C=C3F)C4=CC(=CC=C4)C(=O)O)F)NC5=CC=CC=C25)F

DOS

IR

Vibrations