Geometry & MOs

Info

ID:	321475
PubChem CID:	126666114
Reduced:	ClN4O4H21C23 (1)
Stoich.:	AB4C4D21E23 (1)
Weight, g/mol:	233.116427
ΔH_f, kcal/mol:	-38.8
Dipole, Da:	4.31
IP(EA), eV:	-9.16(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-2-azido-4-phenylmethoxycyclopentan-1-ol

Drug info:

PubChemData

Smile

CC1=NOC2=C1C(=O)N(N=C2C3=C(C=CC(=C3)C(=O)NC)OC)[C@H](C)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations