Geometry & MOs

Info

ID:	442477
PubChem CID:	135252358
Reduced:	NS2O3H27C29 (1)
Stoich.:	AB2C3D27E29 (1)
Weight, g/mol:	383.342936
ΔH_f, kcal/mol:	-11.16
Dipole, Da:	8.37
IP(EA), eV:	-8.62(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(12-ethyl-2,2,5,7,7,9,9,14,14-nonamethyl-3,4,11-triazabicyclo[6.6.0]tetradecan-4-yl)phosphane

Drug info:

PubChemData

Smile

CCC/C(=N\OC(=O)C)/C1=CC=C(C=C1)SC2=CC=C(C=C2)C(=O)C3=C(C4=CC=CC=C4S3)CC

DOS

IR

Vibrations