Geometry & MOs

Info

ID:	293957
PubChem CID:	117420127
Reduced:	N2O3C14H22 (1)
Stoich.:	A2B3C14D22 (1)
Weight, g/mol:	266.163043
ΔH_f, kcal/mol:	-126.39
Dipole, Da:	6.78
IP(EA), eV:	-8.96(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-(2-aminopropyl)-6-hydroxyphenyl]carbamate

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1)C(CCC(=O)O)N)O)CN(C)C

DOS

IR

Vibrations