Geometry & MOs

Info

ID:	221905
PubChem CID:	85292620
Reduced:	NSO4C20H25 (1)
Stoich.:	ABC4D20E25 (1)
Weight, g/mol:	375.32094
ΔH_f, kcal/mol:	-109.07
Dipole, Da:	4.87
IP(EA), eV:	-8.7(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[1-[3-[4-(3-aminopropylamino)butylamino]propylamino]-3-hydroxypropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=C(C=C2)OC)CC3(CO3)C

DOS

IR

Vibrations