Geometry & MOs

Info

ID:	281831
PubChem CID:	103914432
Reduced:	O2N3C18H37 (1)
Stoich.:	A2B3C18D37 (1)
Weight, g/mol:	322.192629
ΔH_f, kcal/mol:	-157.11
Dipole, Da:	2.68
IP(EA), eV:	-8.44(1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[4-(1-ethylsulfonylpropan-2-ylamino)butan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)CN1CCC(CC1)NCCC(C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations