Geometry & MOs

Info

ID:	370941
PubChem CID:	127341426
Reduced:	SO3N4C18H28 (1)
Stoich.:	AB3C4D18E28 (1)
Weight, g/mol:	394.170848
ΔH_f, kcal/mol:	-80.26
Dipole, Da:	6.08
IP(EA), eV:	-8.98(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N,4-N-bis(cyclopropylmethyl)-1-N,4-N-dimethyl-1,4-diazepane-1,4-disulfonamide

Drug info:

PubChemData

Smile

CN(CC1CC1)S(=O)(=O)N2CCN(CC2)CC(=O)NCC3=CC=CC=C3

DOS

IR

Vibrations